(2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate

C16H14N2O6 — CID 7879888

IUPAC(2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate
SMILESO=C(COC(=O)CNC(=O)c1ccco1)NC(=O)c1ccccc1
InChIInChI=1S/C16H14N2O6/c19-13(18-15(21)11-5-2-1-3-6-11)10-24-14(20)9-17-16(22)12-7-4-8-23-12/h1-8H,9-10H2,(H,17,22)(H,18,19,21)
InChIKeyGHTRHDLIGTYUSW-UHFFFAOYSA-N
MW330.30 g/mol
LogP0.51
Rot. Bonds6

About (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate

(2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate (PubChem CID 7879888) has the molecular formula C16H14N2O6 and a molecular weight of 330.30 g/mol. Its IUPAC name is (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate.

Molecular Properties

Compound Name(2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate
PubChem CID7879888
Molecular FormulaC16H14N2O6
Molecular Weight330.30 g/mol
Exact Mass330.09
IUPAC Name(2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate
SMILESO=C(COC(=O)CNC(=O)c1ccco1)NC(=O)c1ccccc1
InChIInChI=1S/C16H14N2O6/c19-13(18-15(21)11-5-2-1-3-6-11)10-24-14(20)9-17-16(22)12-7-4-8-23-12/h1-8H,9-10H2,(H,17,22)(H,18,19,21)
InChIKeyGHTRHDLIGTYUSW-UHFFFAOYSA-N
XLogP0.51
TPSA114.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.30
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2-benzamido-2-oxoethyl) furan-2-carboxylate
CID 7486704
[2-(furan-2-carbonylamino)-2-oxoethyl] 2-[(3-bromobenzoyl)amino]acetate
CID 24557824
[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] 2-(furan-2-carbonylamino)acetate
CID 7880281
[2-(2-fluoroanilino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
CID 7880328
[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl] 2-(furan-2-carbonylamino)acetate
CID 2427987
(2-benzamido-2-oxoethyl) 2-[(2-iodobenzoyl)amino]acetate
CID 55307473
[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
CID 7880332
[2-(2-ethoxyanilino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
CID 7880201
[2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] 2-[(4-ethoxybenzoyl)amino]acetate
CID 7884691
[2-[(4-tert-butylbenzoyl)amino]-2-oxoethyl] furan-2-carboxylate
CID 7814464
[2-(3-chloroanilino)-2-oxoethyl] 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate
CID 8871080
[2-(2-methylsulfanylanilino)-2-oxoethyl] 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate
CID 8875399

Frequently Asked Questions

What is the IUPAC name of (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate?
The IUPAC name of (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate (CID 7879888) is (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate.
What is the SMILES notation for (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate?
The canonical SMILES for (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate is O=C(COC(=O)CNC(=O)c1ccco1)NC(=O)c1ccccc1.
What is the InChIKey of (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate?
The InChIKey is GHTRHDLIGTYUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O6/c19-13(18-15(21)11-5-2-1-3-6-11)10-24-14(20)9-17-16(22)12-7-4-8-23-12/h1-8H,9-10H2,(H,17,22)(H,18,19,21).
What are the key properties of (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate?
(2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate has a molecular weight of 330.30 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-benzamido-2-oxoethyl) 2-(furan-2-carbonylamino)acetate is sourced from PubChem (CID 7879888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).